Cas no 622-50-4 (N-(4-Iodophenyl)acetamide)

N-(4-Iodophenyl)acetamide is a halogenated aromatic compound featuring an acetamide group para-substituted with an iodine atom on the phenyl ring. This structure imparts unique reactivity, making it valuable as an intermediate in organic synthesis, particularly in cross-coupling reactions such as the Suzuki-Miyaura or Buchwald-Hartwig couplings. The iodine substituent enhances its utility in palladium-catalyzed transformations, enabling efficient functionalization. Its crystalline solid form and well-defined melting point ensure consistent handling and purification. The compound is also employed in pharmaceutical and agrochemical research for constructing complex molecules. High purity grades are available to meet stringent synthetic requirements.
N-(4-Iodophenyl)acetamide structure
N-(4-Iodophenyl)acetamide structure
Product Name:N-(4-Iodophenyl)acetamide
CAS No:622-50-4
MF:C8H8INO
MW:261.059694290161
MDL:MFCD00016352
CID:39096
PubChem ID:12147
Update Time:2025-10-17

N-(4-Iodophenyl)acetamide Chemical and Physical Properties

Names and Identifiers

    • N-(4-Iodophenyl)acetamide
    • 4'-Iodoacetanilide
    • 4-(N-acetylamino)iodobenzene
    • 4-acetamidoiodobenzene
    • 4-Iodoacetanilide
    • 4-iodo-N-acetylaminobenzene
    • Acetamide,N-(4-iodophenyl)
    • ACETANILIDE,4'-IODO
    • N-(4-iodo-phenyl)-acetamide
    • para-acetamino-iodo-benzene
    • p-Iodoacetanilide
    • Acetanilide,4'-iodo- (6CI,7CI,8CI)
    • 4-Acetamidophenyl iodide
    • NSC 2161
    • p-Acetamidoiodobenzene
    • Acetamide, N-(4-iodophenyl)-
    • SIULLDWIXYYVCU-UHFFFAOYSA-N
    • 4'-Iodo-acetanilide
    • PubChem3293
    • Maybridge1_006480
    • WLN: IR DMV1
    • N-(4-iodophenyl)-acetamide
    • N-(4-iodophenyl) acetamide
    • Acetamide,N-(
    • AH-034/05420003
    • AKOS002813447
    • Acetamide, N-(4-iodophenyl-)-
    • 4-12-00-01546 (Beilstein Handbook Reference)
    • SCHEMBL669782
    • Z30316374
    • FT-0618774
    • BRN 2085726
    • HMS559O12
    • CCG-56184
    • AC-22934
    • I0846
    • doi:10.14272/SIULLDWIXYYVCU-UHFFFAOYSA-N
    • AI3-23888
    • CS-W004143
    • DTXSID7060752
    • AM20040882
    • 1Y-0922
    • 622-50-4
    • NSC-2161
    • ACETANILIDE, 4'-IODO-
    • SR-01000645158-1
    • F21272
    • SY051203
    • MFCD00016352
    • EN300-384681
    • NSC2161
    • 10.14272/SIULLDWIXYYVCU-UHFFFAOYSA-N
    • NS00034979
    • A833676
    • DTXCID5043267
    • para-iodoacetanilide
    • FI70546
    • 612-973-4
    • MDL: MFCD00016352
    • Inchi: 1S/C8H8INO/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,1H3,(H,10,11)
    • InChI Key: SIULLDWIXYYVCU-UHFFFAOYSA-N
    • SMILES: IC1C=CC(=CC=1)NC(C)=O
    • BRN: 2085726

Computed Properties

  • Exact Mass: 260.96500
  • Monoisotopic Mass: 260.965
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 141
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 2.7
  • Topological Polar Surface Area: 29.1

Experimental Properties

  • Color/Form: Bluish gray to purple powder
  • Density: 1.7396 (estimate)
  • Melting Point: 182.0 to 187.0 deg-C
  • Boiling Point: 310.8°C at 760 mmHg
  • Flash Point: 141.8°C
  • Refractive Index: 1.701
  • PSA: 29.10000
  • LogP: 2.32260
  • FEMA: 2349

N-(4-Iodophenyl)acetamide Security Information

N-(4-Iodophenyl)acetamide Customs Data

  • HS CODE:2924299090
  • Customs Data:

    China Customs Code:

    2924299090

    Overview:

    2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Summary:

    2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

N-(4-Iodophenyl)acetamide Pricemore >>

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N-(4-Iodophenyl)acetamide Suppliers

Amadis Chemical Company Limited
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(CAS:622-50-4)N-(4-Iodophenyl)acetamide
Order Number:A833676
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:34
Price ($):352.0

Additional information on N-(4-Iodophenyl)acetamide

Introduction to N-(4-Iodophenyl)acetamide (CAS No. 622-50-4)

N-(4-Iodophenyl)acetamide, with the chemical formula C8H7INO, is a significant compound in the realm of pharmaceutical and biochemical research. This compound, identified by its CAS number 622-50-4, has garnered considerable attention due to its versatile applications in synthetic chemistry and drug development. The presence of an iodine atom at the para position of the phenyl ring and the acetamide functional group makes it a valuable intermediate in various chemical transformations.

The structural features of N-(4-Iodophenyl)acetamide contribute to its reactivity, making it a preferred choice for researchers exploring novel synthetic pathways. The iodine substituent facilitates various coupling reactions, including Suzuki-Miyaura and Sonogashira couplings, which are pivotal in constructing complex molecular architectures. Additionally, the acetamide group can undergo further modifications, such as hydrolysis or amidation, to yield diverse derivatives with tailored biological activities.

In recent years, N-(4-Iodophenyl)acetamide has been extensively studied for its potential in medicinal chemistry. Its incorporation into pharmacophores has led to the development of novel compounds with therapeutic implications. For instance, researchers have explored its use in designing kinase inhibitors, which are crucial in treating various cancers and inflammatory diseases. The iodine atom serves as a handle for further functionalization, enabling the creation of highly specific inhibitors targeting disease-causing enzymes.

Moreover, the compound has found applications in materials science, particularly in the synthesis of organic semiconductors and luminescent materials. The electron-withdrawing nature of the acetamide group and the presence of the iodine atom contribute to its ability to form stable conjugated systems, which are essential for optoelectronic applications. Recent studies have demonstrated its role in developing organic light-emitting diodes (OLEDs) and photovoltaic cells, highlighting its importance beyond pharmaceuticals.

The synthesis of N-(4-Iodophenyl)acetamide typically involves the reaction of 4-iodobenzoyl chloride with ammonia or ammonium hydroxide. This straightforward approach yields the desired product with high purity, making it readily accessible for further applications. However, researchers have also explored alternative synthetic routes to optimize yield and minimize byproducts. For example, catalytic methods using transition metals have been investigated to enhance the efficiency of the reaction.

Recent advancements in computational chemistry have further expanded the utility of N-(4-Iodophenyl)acetamide. Molecular modeling studies have provided insights into its interactions with biological targets, aiding in the rational design of drug candidates. These simulations have revealed that the compound can effectively bind to proteins involved in metabolic pathways, suggesting its potential as an antimicrobial agent. Such findings underscore the importance of computational tools in modern drug discovery.

The safety profile of N-(4-Iodophenyl)acetamide is another critical aspect that has been thoroughly evaluated. While it is not classified as a hazardous material under standard regulatory guidelines, proper handling procedures must be followed to ensure safe laboratory practices. Researchers should adhere to established protocols for handling organic compounds, including personal protective equipment (PPE) and adequate ventilation.

In conclusion, N-(4-Iodophenyl)acetamide (CAS No. 622-50-4) is a multifaceted compound with significant applications in pharmaceuticals and materials science. Its unique structural features enable diverse chemical transformations and biological activities, making it a valuable tool for researchers across various disciplines. As our understanding of its properties continues to evolve, so too will its applications in advancing scientific knowledge and technological innovation.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:622-50-4)N-(4-Iodophenyl)acetamide
A833676
Purity:99%
Quantity:100g
Price ($):352.0
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